SCHEMBL8427597

SCHEMBL8427597

N#C/C(=C\c1ccc([N+](=O)[O-])s1)S(=O)(=O)c1ccsc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.37
ALDH1A1 P00352 7/20 0.37
HTT P42858 6/20 0.37
KDM4E B2RXH2 5/20 0.37
L3MBTL1 Q9Y468 5/20 0.37
MITF O75030 4/20 0.37
PPME1 Q9Y570 2/20 0.36
LMNA P02545 8/20 0.34
KMT2A Q03164 7/20 0.34
MEN1 O00255 5/20 0.34
NPC1 O15118 2/20 0.34
SMN1; SMN2 Q16637 4/20 0.34
GAA P10253 1/20 0.34
PKM P14618 2/20 0.33
RECQL P46063 2/20 0.33
POLB P06746 2/20 0.33
HSP90AA1 P07900 2/20 0.33
RAB9A P51151 2/20 0.33
HPGD P15428 1/20 0.33
ATM Q13315 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8427599 1.00 MAPT (0.37) MAPTALDH1A1HTTKDM4EL3MBTL1
SCHEMBL8427601 1.00 MAPT (0.37) MAPTALDH1A1HTTKDM4EL3MBTL1
SCHEMBL8425883 0.84 PKM (0.49) MAPTALDH1A1HTTKDM4EL3MBTL1
SCHEMBL8425885 0.84 PKM (0.49) MAPTALDH1A1HTTKDM4EL3MBTL1
SCHEMBL8425886 0.84 PKM (0.49) MAPTALDH1A1HTTKDM4EL3MBTL1
SCHEMBL8425618 0.83 PKM (0.51) MAPTALDH1A1HTTKDM4EL3MBTL1
SCHEMBL8425615 0.83 PKM (0.51) MAPTALDH1A1HTTKDM4EL3MBTL1
SCHEMBL8425622 0.83 PKM (0.51) MAPTALDH1A1HTTKDM4EL3MBTL1
SCHEMBL9099716 0.81 MAPT (0.44) MAPTALDH1A1HTTKDM4EL3MBTL1
SCHEMBL9099709 0.81 MAPT (0.44) MAPTALDH1A1HTTKDM4EL3MBTL1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5886195-A REACTING AN APPROPRIATE CARBOXALDEHYDE WITH AN APPROPRIATE SULFONYLACETONITRILE SUGEN, INC. (US) 1999-03-23 US claimed
WO-1996040675-A1 THIENYL COMPOUNDS FOR INHIBITION OF CELL PROLIFERATIVE DISORDERS SUGEN, INC. (US) 1996-12-19 WO claimed
US-5886195-A REACTING AN APPROPRIATE CARBOXALDEHYDE WITH AN APPROPRIATE SULFONYLACETONITRILE SUGEN, INC. (US) 1999-03-23 US disclosed
US-5710173-A ANTITUMOR AGENTS OR ANTICARCINOGENIC AGENTS SUGEN, INC. (US) 1998-01-20 US disclosed
WO-1996040675-A1 THIENYL COMPOUNDS FOR INHIBITION OF CELL PROLIFERATIVE DISORDERS SUGEN, INC. (US) 1996-12-19 WO disclosed